N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide
TL;DR: N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide (CAS 38250-74-7) is a chemical compound with molecular formula C12H8ClNO3S and molecular weight 280.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide
Also Known As: N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide, Benzenesulfonamide, N-(3-chloro-4-oxo-2,5-cyclohexadien-1-ylidene)-, Benzenesulfonamide,N-(3-chloro-4-oxo-2,5-cyclohexadien-1-ylidene)
| Molecular Formula | C12H8ClNO3S |
|---|---|
| Molecular Weight | 280.99 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.99133 |
| Heavy Atoms | 18 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 38250-74-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N=C2C=CC(=O)C(=C2)Cl |
| InChIKey | DYQGPTHSJLQSES-UHFFFAOYSA-N |
Product Overview
N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide (CAS 38250-74-7), with molecular formula C12H8ClNO3S and molecular weight 280.99 g/mol. IUPAC: N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide.
Chemical Property Profile of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide
Property Insights of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide. Following Lipinski's Rule of Five, N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide?
The CAS number of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide is 38250-74-7.
What is the molecular formula of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide?
The molecular formula of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide is C12H8ClNO3S.
What is the molecular weight of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide?
The molecular weight of N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide is 280.99 g/mol.
Where can I buy N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide?
You can request a quote for N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-oxocyclohexa-2,5-dien-1-ylidene)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.